Disodiumstannouscitrate

C6H8Na2O7Sn — CID 139269644

IUPAC—
SMILESO=C(O)CC(O)(CC(=O)O)C(=O)O.[Na].[Na].[Sn]
InChIInChI=1S/C6H8O7.2Na.Sn/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;
InChIKeySWSJSCHGMOUPQM-UHFFFAOYSA-N
MW356.81 g/mol
LogP-2.39
Rot. Bonds5

About Disodiumstannouscitrate

Disodiumstannouscitrate (PubChem CID 139269644) has the molecular formula C6H8Na2O7Sn and a molecular weight of 356.81 g/mol.

Molecular Properties

Compound NameDisodiumstannouscitrate
PubChem CID139269644
Molecular FormulaC6H8Na2O7Sn
Molecular Weight356.81 g/mol
Exact Mass357.91
IUPAC Name—
SMILESO=C(O)CC(O)(CC(=O)O)C(=O)O.[Na].[Na].[Sn]
InChIInChI=1S/C6H8O7.2Na.Sn/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;
InChIKeySWSJSCHGMOUPQM-UHFFFAOYSA-N
XLogP-2.39
TPSA132.13 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 5-2.39
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

CID 87184526
CID 87184526
tris(2-hydroxypropane-1,2,3-tricarboxylic acid);dihydrate
CID 172729585
2-hydroxypropane-1,2,3-tricarboxylic acid;manganese
CID 90472972
2-hydroxypropane-1,2,3-tricarboxylic acid;tungsten
CID 89401463
silver 2-hydroxypropane-1,2,3-tricarboxylic acid
CID 11587493
hydrogen peroxide;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
CID 158473512
CID 173004565
CID 173004565
CID 24997986
CID 24997986
tris(2-hydroxypropane-1,2,3-tricarboxylic acid);iron
CID 163216326
2-hydroxypropane-1,2,3-tricarboxylic acid;rhodium(2+)
CID 10469750
carbonic acid;2-hydroxypropane-1,2,3-tricarboxylic acid
CID 87148662
2-hydroxypropane-1,2,3-tricarboxylic acid;molybdenum
CID 56836802

Frequently Asked Questions

What is the IUPAC name of Disodiumstannouscitrate?
The IUPAC name of Disodiumstannouscitrate (CID 139269644) is not available.
What is the SMILES notation for Disodiumstannouscitrate?
The canonical SMILES for Disodiumstannouscitrate is O=C(O)CC(O)(CC(=O)O)C(=O)O.[Na].[Na].[Sn].
What is the InChIKey of Disodiumstannouscitrate?
The InChIKey is SWSJSCHGMOUPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O7.2Na.Sn/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;.
What are the key properties of Disodiumstannouscitrate?
Disodiumstannouscitrate has a molecular weight of 356.81 g/mol, XLogP of -2.39, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for Disodiumstannouscitrate is sourced from PubChem (CID 139269644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).